(2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone

C11H20N2O2 — CID 82756349

IUPAC(2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
SMILESC[C@@H]1CNCCN1C(=O)C1(C)CCCO1
InChIInChI=1S/C11H20N2O2/c1-9-8-12-5-6-13(9)10(14)11(2)4-3-7-15-11/h9,12H,3-8H2,1-2H3/t9-,11?/m1/s1
InChIKeyNWXCCXQEFFMGEM-BFHBGLAWSA-N
MW212.29 g/mol
LogP0.38
Rot. Bonds1

About (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone

(2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone (PubChem CID 82756349) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone.

Molecular Properties

Compound Name(2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
PubChem CID82756349
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name(2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
SMILESC[C@@H]1CNCCN1C(=O)C1(C)CCCO1
InChIInChI=1S/C11H20N2O2/c1-9-8-12-5-6-13(9)10(14)11(2)4-3-7-15-11/h9,12H,3-8H2,1-2H3/t9-,11?/m1/s1
InChIKeyNWXCCXQEFFMGEM-BFHBGLAWSA-N
XLogP0.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2S)-2-methylpiperazin-1-yl]ethanone
CID 54446440
1-[(2R)-2-methylpiperazin-1-yl]ethanone
CID 55300442
(2-methylpiperazin-1-yl)-(4-phenyloxan-4-yl)methanone
CID 82250270
(2S)-2-methylpiperazine-1-carboxamide
CID 66855874
3-methyl-1-[(2S)-2-methylpiperazin-1-yl]but-2-en-1-one
CID 82704652
(2S)-2-methyl-N-propan-2-ylpiperazine-1-carboxamide
CID 82756259
1-(2-methylpiperazin-1-yl)propan-1-one
CID 10820824
1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone
CID 82704997
[(1R,2R)-2-methylcyclopropyl]-(2-methylpiperazin-1-yl)methanone
CID 155385369
(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
CID 82755754
7-bicyclo[4.1.0]heptanyl-[(2S)-2-methylpiperazin-1-yl]methanone
CID 82704835
(2,2-difluorocyclopropyl)-[(2R)-2-methylpiperazin-1-yl]methanone
CID 165368993

Frequently Asked Questions

What is the IUPAC name of (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
The IUPAC name of (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone (CID 82756349) is (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone.
What is the SMILES notation for (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
The canonical SMILES for (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone is C[C@@H]1CNCCN1C(=O)C1(C)CCCO1.
What is the InChIKey of (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
The InChIKey is NWXCCXQEFFMGEM-BFHBGLAWSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9-8-12-5-6-13(9)10(14)11(2)4-3-7-15-11/h9,12H,3-8H2,1-2H3/t9-,11?/m1/s1.
What are the key properties of (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
(2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone has a molecular weight of 212.29 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone is sourced from PubChem (CID 82756349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).